SCHEMBL1727019

SCHEMBL1727019

C=C(C)C(=O)OCC[N+](C)(C)CC.CCOS(=O)(=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
TSHR P16473 3/20 0.40
BBOX1 O75936 2/20 0.35
CHRM5 P08912 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GALR3 O60755 2/20 0.31
PGR P06401 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
HTR1A P08908 1/20 0.31
CHRNB2 P17787 1/20 0.31
TBXA2R P21731 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CHRNA10 Q9GZZ6 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Sulfuric Acid SCHEMBL3256604 0.90 THRB (0.46) THRBTSHRBBOX1CHRM5CHRM1
SCHEMBL1847546 0.89 THRB (0.46) THRBTSHRCHRM5CHRM1CHRM3
SCHEMBL9087691 0.89 THRB (0.42) THRBTSHRBBOX1CHRM5CHRM1
SCHEMBL968126 0.87 THRB (0.45) THRBTSHRCHRM5CHRM1CHRM3
SCHEMBL6896456 0.87 THRB (0.45) THRBTSHRCHRM5CHRM1CHRM3
Sulfuric Acid SCHEMBL11784028 0.85 THRB (0.47) THRBTSHRBBOX1CHRM5CHRM1
Hydrochloric Acid SCHEMBL475871 0.85 THRB (0.53) THRBTSHRBBOX1CHRM5CHRM1
SCHEMBL1598354 0.85 THRB (0.53) THRBTSHRBBOX1CHRM5CHRM1
Bromide SCHEMBL4367449 0.83 THRB (0.52) THRBTSHRBBOX1CHRM5CHRM1
SCHEMBL1578790 0.82 BBOX1 (0.39) BBOX1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 140 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3143098-B1 POLYMER AND SURFACTANT COMPOSITIONS AND THEIR USES FOR THE IMPROVED RECOVERY OF HYDROCARBONS TOTAL SE (FR) 2021-02-10 EP claimed
EP-2138154-B1 Hair rinse with amphotenside and special storage life BEIERSDORF AG (DE) 2018-07-25 EP claimed
WO-2016022161-A1 KERATIN CONDITIONING POLYMERS FOR USE IN PERSONAL CARE COMPOSITONS BASF SE (DE) 2016-02-11 WO claimed
WO-2015054452-A1 KERATIN CONDITIONING BIO-BASED POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS BASF SE (DE) 2015-04-16 WO claimed
US-20140147399-A1 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS BASF SE (DE) 2014-05-29 US claimed
US-8663612-B2 Ampholytic ter-polymers for use in personal care compositions BASF SE (DE) 2014-03-04 US claimed
US-20100226868-A1 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS BASF SE (DE) 2010-09-09 US claimed
EP-0958296-A1 NOVEL HETEROCYCLIC COMPOUNDS PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED DISEASES DR. REDDY'S RESEARCH FOUNDATION (IN) 1999-11-24 EP claimed
WO-1997041097-A2 NOVEL HETEROCYCLIC COMPOUNDS PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED DISEASES DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-11-06 WO claimed
EP-4570322-A1 OIL-IN-WATER-TYPE EMULSION COMPOSITION Kao Corporation (JP) 2025-06-18 EP disclosed
CN-119584950-A Oil-in-water emulsion composition 花王株式会社 2025-03-07 CN disclosed
US-20250051696-A1 DETERGENT COMPOSITION KAO CORPORATION (JP) 2025-02-13 US disclosed
EP-4455257-A1 CLEANING AGENT COMPOSITION Kao Corporation (JP) 2024-10-30 EP disclosed
CN-118451170-A Cleaning agent composition 花王株式会社 2024-08-06 CN disclosed
EP-0796874-A2 Process for the preparation of polymers containing peroxycarboxylic groups BASF AKTIENGESELLSCHAFT (DE) 1997-09-24 EP disclosed
US-5662971-A SAUSAGE HOECHST AKTIENGESELLSCHAFT (DE) 1997-09-02 US disclosed
EP-0757892-A1 Sheet or tube-like food casings based on cellulose hydrate Kalle Nalo GmbH (DE) 1997-02-12 EP disclosed
US-5501886-A VINYLPYRROLIDONE HOMOPOLYMER OR COPOLYMER HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-26 US disclosed
EP-0638241-A1 Food casing based on cellulose having improved ripening properties HOECHST AKTIENGESELLSCHAFT (DE) 1995-02-15 EP disclosed
EP-0635212-A1 Sheet- or tube-like film based on cellulose hydrate HOECHST AKTIENGESELLSCHAFT (DE) 1995-01-25 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140147399-A1 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS KRT18, CUTA, PRKDC THRB 986/4885TSHR 1462/4885BBOX1 672/4885
US-20100226868-A1 AMPHOLYTIC TER-POLYMERS FOR USE IN PERSONAL CARE COMPOSITIONS KRT18, CUTA, PRKDC THRB 986/4885TSHR 1462/4885BBOX1 672/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.